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CHEBI:85791 - N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:85791
ChEBI NameN-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII NameN-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine
DefinitionAn N-acylphosphatidylethanolamine in which the N-acyl group is specified as stearoyl (octadecanoyl) while the phosphatidyl acyl groups are both specified as oleoyl (9Z-octadecenoyl).
Last Modified19 May 2015
SubmitterSteve
DownloadsMolfile
FormulaC59H112NO9P
Net Charge0
Average Mass1010.517
Monoisotopic Mass1009.80747
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C59H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-57(61)60-52-53-67-70(64,65)68-55-56(69-59(63)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)54-66-58(62)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h26-27,29-30,56H,4-25,28,31-55H2,1-3H3,(H,60,61)(H,64,65)/b29-26-,30-27-/t56-/m1/s1
InChIKeyGNAPJEPSPJZGSJ-WJOAKYJCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) has functional parent octadecanoic acid (CHEBI:28842)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) has functional parent oleic acid (CHEBI:16196)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) is a N-acylphosphatidylethanolamine (CHEBI:61232)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) is conjugate acid of N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85292)
Incoming Relation(s)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85292) is conjugate base of N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791)
IUPAC Name 
(2R)-5-hydroxy-2-{[(9Z)-octadec-9-enoyl]oxy}-5,10-dioxo-4,6-dioxa-9-aza-5λ5-phosphaheptacosan-1-yl (9Z)-octadec-9-enoate
Synonym  Source
N-octadecanoyl-1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamineChEBI